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Substance Name: Thiazole, 4,5-dihydro-4,4-dimethyl-2-(2-(3-nitrophenyl)ethenyl)-
RN: 53088-11-2
InChIKey: ODNYBWYIVMZJBL-VOTSOKGWSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C13-H14-N2-O2-S

Molecular Weight

  • 262.3316
 
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Names and Synonyms

Synonyms

  • 4,4-Dimethyl-2-(2-(3-nitrophenyl)ethenyl)-4,5-dihydrothiazole
  • 4,4-Dimethyl-2-(2-(m-nitrophenyl)ethenyl)-2-thiazoline
  • 4,4-Dimethyl-2-(2-m-nitrophenylaethenyl)-2-thiazolin
  • 4,4-Dimethyl-2-(2-m-nitrophenylaethenyl)-2-thiazolin [German]
  • P-1897

Systematic Name

  • Thiazole, 4,5-dihydro-4,4-dimethyl-2-(2-(3-nitrophenyl)ethenyl)-

Registry Numbers

CAS Registry Number

  • 53088-11-2

System Generated Number

  • 0053088112

Structure Descriptors

InChI

1S/C13H14N2O2S/c1-13(2)9-18-12(14-13)7-6-10-4-3-5-11(8-10)15(16)17/h3-8H,9H2,1-2H3/b7-6+

InChIKey

ODNYBWYIVMZJBL-VOTSOKGWSA-N

Smiles

CC1(CSC(=N1)/C=C/c2cccc(c2)[N+](=O)[O-])C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 320mg/kg (320mg/kg)   United States Patent Document. Vol. #3911131,
mouse LD50 oral 1220mg/kg (1220mg/kg)   United States Patent Document. Vol. #3911131,